ethyl 4-[5-(5-chloranylpyridin-2-yl)sulfanyl-1-methyl-imidazol-4-yl]benzoate

Systemtic Name: ethyl 4-[5-(5-chloranylpyridin-2-yl)sulfanyl-1-methyl-imidazol-4-yl]benzoate Openeye Name: ethyl 4-[5-[(5-chloro-2-pyridyl)sulfanyl]-1-methyl-imidazol-4-yl]benzoate CAS Name: 4-[5-[(5-chloro-2-pyridinyl)thio]-1-methyl-4-imidazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-(5-chloropyridin-2-yl)sulfanyl-1-methylimidazol-4-yl]benzoate Traditional Name: 4-[5-[(5-chloro-2-pyridyl)thio]-1-methyl-imidazol-4-yl]benzoic acid ethyl ester Formula: C18H16ClN3O2S MolecularWeight: 373.85654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=C(N(C=N2)C)SC3=NC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=C(N(C=N2)C)SC3=NC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN3O2S/c1-3-24-18(23)13-6-4-12(5-7-13)16-17(22(2)11-21-16)25-15-9-8-14(19)10-20-15/h4-11H,3H2,1-2H3